| SpectraBase Spectrum ID |
C477mheO6Y7 |
| Name |
4-[3-[[(E)-2-[2-methoxyethoxy(oxo)methyl]-3-oxobut-1-enyl]amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
500.215865990 u |
| Formula |
C26H32N2O8 |
| InChI |
InChI=1S/C26H32N2O8/c1-7-35-26(32)22-16(3)28-15(2)21(25(31)34-6)23(22)18-9-8-10-19(13-18)27-14-20(17(4)29)24(30)36-12-11-33-5/h8-10,13-14,23,27-28H,7,11-12H2,1-6H3/b20-14+ |
| InChIKey |
SGCYOEXYFXXENJ-XSFVSMFZSA-N |
| Molecular Weight |
500.548 g/mol |
| SMILES |
C=1(C(C(C(=O)OCC)=C(NC1C)C)C=1C=C(N\C=C\(C(=O)OCCOC)C(=O)C)C=CC1)C(=O)OC |
![4-[3-[[(E)-2-[2-methoxyethoxy(oxo)methyl]-3-oxobut-1-enyl]amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester](/api/spectrum/C477mheO6Y7/structure.png?h=300&w=458 "4-[3-[[(E)-2-[2-methoxyethoxy(oxo)methyl]-3-oxobut-1-enyl]amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester")
